Chem
J-GLOBAL ID：200907097377330157
Nikkaji number：J982.714E
12-Methyl-13-bromo-11-thiabicyclo[8.2.1]trideca-1(12),10(13)-diene
12-メチル-13-ブロモ-11-チアビシクロ[8.2.1]トリデカ-1(12),10(13)-ジエン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C13H19BrS
Molecular formula furigana： C13-H19-BR-S
Molecular weight： 287.260
InChI：
InChI=1S/C13H19BrS/c1-10-11-8-6-4-2-3-5-7-9-12(15-10)13(11)14/h2-9H2,1H3
InChI key：
XHKCMKVQMISZLA-UHFFFAOYSA-N
SMILES：
Cc1sc2CCCCCCCCc1c2Br
Systematic name (3)：
- 12-メチル-13-ブロモ-11-チアビシクロ[8.2.1]トリデカ-1(12),10(13)-ジエン
- 13-ブロモ-12-メチル-11-チアビシクロ[8.2.1]トリデカ-1(12),10(13)-ジエン
- 13-bromo-12-methyl-11-thiabicyclo[8.2.1]trideca-1(12),10(13)-diene
- 12-Methyl-13-bromo-11-thiabicyclo[8.2.1]trideca-1(12),10(13)-diene
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